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root/OpenMD/trunk/src/applications/dynamicProps/DynamicPropsCmd.cpp
Revision: 1795
Committed: Fri Sep 7 18:13:55 2012 UTC (12 years, 7 months ago) by gezelter
File size: 30040 byte(s)
Log Message:
Windows fixes

File Contents

# User Rev Content
1 tim 320 /*
2 gezelter 1629 File autogenerated by gengetopt version 2.22.4
3 tim 320 generated with the following command:
4 gezelter 1629 gengetopt -F DynamicPropsCmd -u
5 tim 320
6     The developers of gengetopt consider the fixed text that goes in all
7     gengetopt output files to be in the public domain:
8     we make no copyright claims on it.
9     */
10    
11 chuckv 1098 /* If we use autoconf. */
12     #ifdef HAVE_CONFIG_H
13     #include "config.h"
14     #endif
15 tim 320
16     #include <stdio.h>
17     #include <stdlib.h>
18     #include <string.h>
19    
20 gezelter 1629 #ifndef FIX_UNUSED
21     #define FIX_UNUSED(X) (void) (X) /* avoid warnings for unused params */
22     #endif
23 tim 320
24 gezelter 1795 #ifdef WIN32
25     #include "utils/wingetopt.h"
26     #else
27 gezelter 1629 #include <getopt.h>
28 gezelter 1795 #endif
29 gezelter 1629
30 tim 320 #include "DynamicPropsCmd.h"
31    
32 gezelter 1629 const char *gengetopt_args_info_purpose = "";
33    
34     const char *gengetopt_args_info_usage = "Usage: DynamicProps [OPTIONS]... [FILES]...";
35    
36     const char *gengetopt_args_info_description = "";
37    
38     const char *gengetopt_args_info_help[] = {
39     " -h, --help Print help and exit",
40     " -V, --version Print version and exit",
41     " -i, --input=filename input dump file",
42     " -o, --output=filename output file name",
43     " --sele1=selection script select first stuntdouble set",
44     " --sele2=selection script select second stuntdouble set (if sele2 is not \n set, use script from sele1)",
45     " --order=INT Lengendre Polynomial Order",
46     " -m, --memory=memory specification\n Available memory (defaults to 2G) \n (default=`2G')",
47     "\n Group: dynamicProps\n an option of this group is required",
48     " -r, --rcorr rmsd",
49     " -v, --vcorr velocity correlation function",
50     " -d, --dcorr dipole correlation function",
51     " -l, --lcorr Lengendre correlation function",
52     " -s, --sdcorr System dipole correlation function",
53     " --r_rcorr Radial rmsd",
54     " --thetacorr Angular rmsd",
55     " --drcorr Directional rmsd for particles with unit \n vectors",
56     " --helfandEcorr Helfand moment for thermal conductvity",
57     " -p, --momentum Helfand momentum for viscosity",
58     " --stresscorr Stress tensor correlation function",
59     0
60     };
61    
62     typedef enum {ARG_NO
63     , ARG_STRING
64     , ARG_INT
65     } cmdline_parser_arg_type;
66    
67 chuckv 1098 static
68     void clear_given (struct gengetopt_args_info *args_info);
69     static
70     void clear_args (struct gengetopt_args_info *args_info);
71    
72     static int
73 gezelter 1629 cmdline_parser_internal (int argc, char **argv, struct gengetopt_args_info *args_info,
74     struct cmdline_parser_params *params, const char *additional_error);
75 chuckv 1098
76     static int
77     cmdline_parser_required2 (struct gengetopt_args_info *args_info, const char *prog_name, const char *additional_error);
78    
79     static char *
80     gengetopt_strdup (const char *s);
81    
82     static
83     void clear_given (struct gengetopt_args_info *args_info)
84     {
85     args_info->help_given = 0 ;
86     args_info->version_given = 0 ;
87     args_info->input_given = 0 ;
88     args_info->output_given = 0 ;
89     args_info->sele1_given = 0 ;
90     args_info->sele2_given = 0 ;
91     args_info->order_given = 0 ;
92 gezelter 1629 args_info->memory_given = 0 ;
93 chuckv 1098 args_info->rcorr_given = 0 ;
94     args_info->vcorr_given = 0 ;
95     args_info->dcorr_given = 0 ;
96     args_info->lcorr_given = 0 ;
97 gezelter 1629 args_info->sdcorr_given = 0 ;
98 chuckv 1098 args_info->r_rcorr_given = 0 ;
99 chuckv 1112 args_info->thetacorr_given = 0 ;
100 xsun 1183 args_info->drcorr_given = 0 ;
101 chuckv 1245 args_info->helfandEcorr_given = 0 ;
102 gezelter 1629 args_info->momentum_given = 0 ;
103     args_info->stresscorr_given = 0 ;
104 chuckv 1098 args_info->dynamicProps_group_counter = 0 ;
105     }
106    
107     static
108     void clear_args (struct gengetopt_args_info *args_info)
109     {
110 gezelter 1629 FIX_UNUSED (args_info);
111 chuckv 1098 args_info->input_arg = NULL;
112     args_info->input_orig = NULL;
113     args_info->output_arg = NULL;
114     args_info->output_orig = NULL;
115     args_info->sele1_arg = NULL;
116     args_info->sele1_orig = NULL;
117     args_info->sele2_arg = NULL;
118     args_info->sele2_orig = NULL;
119     args_info->order_orig = NULL;
120 gezelter 1629 args_info->memory_arg = gengetopt_strdup ("2G");
121     args_info->memory_orig = NULL;
122 chuckv 1098
123     }
124    
125 gezelter 1629 static
126     void init_args_info(struct gengetopt_args_info *args_info)
127     {
128    
129    
130     args_info->help_help = gengetopt_args_info_help[0] ;
131     args_info->version_help = gengetopt_args_info_help[1] ;
132     args_info->input_help = gengetopt_args_info_help[2] ;
133     args_info->output_help = gengetopt_args_info_help[3] ;
134     args_info->sele1_help = gengetopt_args_info_help[4] ;
135     args_info->sele2_help = gengetopt_args_info_help[5] ;
136     args_info->order_help = gengetopt_args_info_help[6] ;
137     args_info->memory_help = gengetopt_args_info_help[7] ;
138     args_info->rcorr_help = gengetopt_args_info_help[9] ;
139     args_info->vcorr_help = gengetopt_args_info_help[10] ;
140     args_info->dcorr_help = gengetopt_args_info_help[11] ;
141     args_info->lcorr_help = gengetopt_args_info_help[12] ;
142     args_info->sdcorr_help = gengetopt_args_info_help[13] ;
143     args_info->r_rcorr_help = gengetopt_args_info_help[14] ;
144     args_info->thetacorr_help = gengetopt_args_info_help[15] ;
145     args_info->drcorr_help = gengetopt_args_info_help[16] ;
146     args_info->helfandEcorr_help = gengetopt_args_info_help[17] ;
147     args_info->momentum_help = gengetopt_args_info_help[18] ;
148     args_info->stresscorr_help = gengetopt_args_info_help[19] ;
149    
150     }
151    
152 tim 320 void
153     cmdline_parser_print_version (void)
154     {
155 gezelter 1629 printf ("%s %s\n",
156     (strlen(CMDLINE_PARSER_PACKAGE_NAME) ? CMDLINE_PARSER_PACKAGE_NAME : CMDLINE_PARSER_PACKAGE),
157     CMDLINE_PARSER_VERSION);
158 tim 320 }
159    
160 gezelter 1629 static void print_help_common(void) {
161     cmdline_parser_print_version ();
162    
163     if (strlen(gengetopt_args_info_purpose) > 0)
164     printf("\n%s\n", gengetopt_args_info_purpose);
165    
166     if (strlen(gengetopt_args_info_usage) > 0)
167     printf("\n%s\n", gengetopt_args_info_usage);
168    
169     printf("\n");
170    
171     if (strlen(gengetopt_args_info_description) > 0)
172     printf("%s\n\n", gengetopt_args_info_description);
173     }
174    
175 tim 320 void
176     cmdline_parser_print_help (void)
177     {
178 gezelter 1629 int i = 0;
179     print_help_common();
180     while (gengetopt_args_info_help[i])
181     printf("%s\n", gengetopt_args_info_help[i++]);
182 tim 320 }
183    
184 chuckv 1098 void
185     cmdline_parser_init (struct gengetopt_args_info *args_info)
186     {
187     clear_given (args_info);
188     clear_args (args_info);
189 gezelter 1629 init_args_info (args_info);
190    
191     args_info->inputs = 0;
192     args_info->inputs_num = 0;
193 chuckv 1098 }
194 tim 320
195 gezelter 1629 void
196     cmdline_parser_params_init(struct cmdline_parser_params *params)
197     {
198     if (params)
199     {
200     params->override = 0;
201     params->initialize = 1;
202     params->check_required = 1;
203     params->check_ambiguity = 0;
204     params->print_errors = 1;
205     }
206     }
207    
208     struct cmdline_parser_params *
209     cmdline_parser_params_create(void)
210     {
211     struct cmdline_parser_params *params =
212     (struct cmdline_parser_params *)malloc(sizeof(struct cmdline_parser_params));
213     cmdline_parser_params_init(params);
214     return params;
215     }
216    
217 chuckv 1098 static void
218 gezelter 1629 free_string_field (char **s)
219     {
220     if (*s)
221     {
222     free (*s);
223     *s = 0;
224     }
225     }
226    
227    
228     static void
229 chuckv 1098 cmdline_parser_release (struct gengetopt_args_info *args_info)
230     {
231 gezelter 1629 unsigned int i;
232     free_string_field (&(args_info->input_arg));
233     free_string_field (&(args_info->input_orig));
234     free_string_field (&(args_info->output_arg));
235     free_string_field (&(args_info->output_orig));
236     free_string_field (&(args_info->sele1_arg));
237     free_string_field (&(args_info->sele1_orig));
238     free_string_field (&(args_info->sele2_arg));
239     free_string_field (&(args_info->sele2_orig));
240     free_string_field (&(args_info->order_orig));
241     free_string_field (&(args_info->memory_arg));
242     free_string_field (&(args_info->memory_orig));
243 chuckv 1098
244 gezelter 1629
245     for (i = 0; i < args_info->inputs_num; ++i)
246     free (args_info->inputs [i]);
247    
248     if (args_info->inputs_num)
249     free (args_info->inputs);
250    
251     clear_given (args_info);
252     }
253    
254    
255     static void
256     write_into_file(FILE *outfile, const char *opt, const char *arg, const char *values[])
257     {
258     FIX_UNUSED (values);
259     if (arg) {
260     fprintf(outfile, "%s=\"%s\"\n", opt, arg);
261     } else {
262     fprintf(outfile, "%s\n", opt);
263     }
264     }
265    
266    
267     int
268     cmdline_parser_dump(FILE *outfile, struct gengetopt_args_info *args_info)
269     {
270     int i = 0;
271    
272     if (!outfile)
273 chuckv 1098 {
274 gezelter 1629 fprintf (stderr, "%s: cannot dump options to stream\n", CMDLINE_PARSER_PACKAGE);
275     return EXIT_FAILURE;
276 chuckv 1098 }
277 gezelter 1629
278     if (args_info->help_given)
279     write_into_file(outfile, "help", 0, 0 );
280     if (args_info->version_given)
281     write_into_file(outfile, "version", 0, 0 );
282     if (args_info->input_given)
283     write_into_file(outfile, "input", args_info->input_orig, 0);
284     if (args_info->output_given)
285     write_into_file(outfile, "output", args_info->output_orig, 0);
286     if (args_info->sele1_given)
287     write_into_file(outfile, "sele1", args_info->sele1_orig, 0);
288     if (args_info->sele2_given)
289     write_into_file(outfile, "sele2", args_info->sele2_orig, 0);
290     if (args_info->order_given)
291     write_into_file(outfile, "order", args_info->order_orig, 0);
292     if (args_info->memory_given)
293     write_into_file(outfile, "memory", args_info->memory_orig, 0);
294     if (args_info->rcorr_given)
295     write_into_file(outfile, "rcorr", 0, 0 );
296     if (args_info->vcorr_given)
297     write_into_file(outfile, "vcorr", 0, 0 );
298     if (args_info->dcorr_given)
299     write_into_file(outfile, "dcorr", 0, 0 );
300     if (args_info->lcorr_given)
301     write_into_file(outfile, "lcorr", 0, 0 );
302     if (args_info->sdcorr_given)
303     write_into_file(outfile, "sdcorr", 0, 0 );
304     if (args_info->r_rcorr_given)
305     write_into_file(outfile, "r_rcorr", 0, 0 );
306     if (args_info->thetacorr_given)
307     write_into_file(outfile, "thetacorr", 0, 0 );
308     if (args_info->drcorr_given)
309     write_into_file(outfile, "drcorr", 0, 0 );
310     if (args_info->helfandEcorr_given)
311     write_into_file(outfile, "helfandEcorr", 0, 0 );
312     if (args_info->momentum_given)
313     write_into_file(outfile, "momentum", 0, 0 );
314     if (args_info->stresscorr_given)
315     write_into_file(outfile, "stresscorr", 0, 0 );
316 chuckv 1098
317 gezelter 1629
318     i = EXIT_SUCCESS;
319     return i;
320 chuckv 1098 }
321 tim 320
322 chuckv 1098 int
323     cmdline_parser_file_save(const char *filename, struct gengetopt_args_info *args_info)
324     {
325     FILE *outfile;
326     int i = 0;
327    
328     outfile = fopen(filename, "w");
329    
330     if (!outfile)
331     {
332     fprintf (stderr, "%s: cannot open file for writing: %s\n", CMDLINE_PARSER_PACKAGE, filename);
333     return EXIT_FAILURE;
334     }
335    
336 gezelter 1629 i = cmdline_parser_dump(outfile, args_info);
337 chuckv 1098 fclose (outfile);
338    
339     return i;
340     }
341    
342     void
343     cmdline_parser_free (struct gengetopt_args_info *args_info)
344     {
345     cmdline_parser_release (args_info);
346     }
347    
348 gezelter 1629 /** @brief replacement of strdup, which is not standard */
349 tim 320 char *
350     gengetopt_strdup (const char *s)
351     {
352 gezelter 1629 char *result = 0;
353 chuckv 1098 if (!s)
354     return result;
355    
356     result = (char*)malloc(strlen(s) + 1);
357 tim 320 if (result == (char*)0)
358     return (char*)0;
359     strcpy(result, s);
360     return result;
361     }
362    
363 chuckv 1098 static void
364     reset_group_dynamicProps(struct gengetopt_args_info *args_info)
365 tim 320 {
366 chuckv 1098 if (! args_info->dynamicProps_group_counter)
367     return;
368 tim 320
369     args_info->rcorr_given = 0 ;
370     args_info->vcorr_given = 0 ;
371     args_info->dcorr_given = 0 ;
372 tim 876 args_info->lcorr_given = 0 ;
373 gezelter 1629 args_info->sdcorr_given = 0 ;
374 chuckv 1098 args_info->r_rcorr_given = 0 ;
375 chuckv 1112 args_info->thetacorr_given = 0 ;
376 xsun 1183 args_info->drcorr_given = 0 ;
377 chuckv 1245 args_info->helfandEcorr_given = 0 ;
378 gezelter 1629 args_info->momentum_given = 0 ;
379     args_info->stresscorr_given = 0 ;
380 chuckv 1098
381     args_info->dynamicProps_group_counter = 0;
382 tim 876 }
383 tim 320
384 chuckv 1098 int
385 gezelter 1629 cmdline_parser (int argc, char **argv, struct gengetopt_args_info *args_info)
386 chuckv 1098 {
387     return cmdline_parser2 (argc, argv, args_info, 0, 1, 1);
388     }
389 tim 320
390 chuckv 1098 int
391 gezelter 1629 cmdline_parser_ext (int argc, char **argv, struct gengetopt_args_info *args_info,
392     struct cmdline_parser_params *params)
393 chuckv 1098 {
394     int result;
395 gezelter 1629 result = cmdline_parser_internal (argc, argv, args_info, params, 0);
396 chuckv 1098
397 gezelter 1629 if (result == EXIT_FAILURE)
398     {
399     cmdline_parser_free (args_info);
400     exit (EXIT_FAILURE);
401     }
402    
403     return result;
404     }
405 chuckv 1098
406 gezelter 1629 int
407     cmdline_parser2 (int argc, char **argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required)
408     {
409     int result;
410     struct cmdline_parser_params params;
411    
412     params.override = override;
413     params.initialize = initialize;
414     params.check_required = check_required;
415     params.check_ambiguity = 0;
416     params.print_errors = 1;
417    
418     result = cmdline_parser_internal (argc, argv, args_info, &params, 0);
419    
420 chuckv 1098 if (result == EXIT_FAILURE)
421     {
422     cmdline_parser_free (args_info);
423     exit (EXIT_FAILURE);
424     }
425    
426     return result;
427     }
428    
429     int
430     cmdline_parser_required (struct gengetopt_args_info *args_info, const char *prog_name)
431     {
432     int result = EXIT_SUCCESS;
433    
434 gezelter 1629 if (cmdline_parser_required2(args_info, prog_name, 0) > 0)
435 chuckv 1098 result = EXIT_FAILURE;
436    
437     if (result == EXIT_FAILURE)
438     {
439     cmdline_parser_free (args_info);
440     exit (EXIT_FAILURE);
441     }
442    
443     return result;
444     }
445    
446     int
447     cmdline_parser_required2 (struct gengetopt_args_info *args_info, const char *prog_name, const char *additional_error)
448     {
449     int error = 0;
450 gezelter 1629 FIX_UNUSED (additional_error);
451 chuckv 1098
452 gezelter 1629 /* checks for required options */
453 chuckv 1098 if (! args_info->input_given)
454     {
455     fprintf (stderr, "%s: '--input' ('-i') option required%s\n", prog_name, (additional_error ? additional_error : ""));
456     error = 1;
457     }
458 gezelter 1629
459 chuckv 1098 if (args_info->dynamicProps_group_counter == 0)
460     {
461 gezelter 1629 fprintf (stderr, "%s: %d options of group dynamicProps were given. One is required%s.\n", prog_name, args_info->dynamicProps_group_counter, (additional_error ? additional_error : ""));
462 chuckv 1098 error = 1;
463     }
464    
465    
466 gezelter 1629 /* checks for dependences among options */
467    
468 chuckv 1098 return error;
469     }
470    
471 gezelter 1629
472     static char *package_name = 0;
473    
474     /**
475     * @brief updates an option
476     * @param field the generic pointer to the field to update
477     * @param orig_field the pointer to the orig field
478     * @param field_given the pointer to the number of occurrence of this option
479     * @param prev_given the pointer to the number of occurrence already seen
480     * @param value the argument for this option (if null no arg was specified)
481     * @param possible_values the possible values for this option (if specified)
482     * @param default_value the default value (in case the option only accepts fixed values)
483     * @param arg_type the type of this option
484     * @param check_ambiguity @see cmdline_parser_params.check_ambiguity
485     * @param override @see cmdline_parser_params.override
486     * @param no_free whether to free a possible previous value
487     * @param multiple_option whether this is a multiple option
488     * @param long_opt the corresponding long option
489     * @param short_opt the corresponding short option (or '-' if none)
490     * @param additional_error possible further error specification
491     */
492     static
493     int update_arg(void *field, char **orig_field,
494     unsigned int *field_given, unsigned int *prev_given,
495     char *value, const char *possible_values[],
496     const char *default_value,
497     cmdline_parser_arg_type arg_type,
498     int check_ambiguity, int override,
499     int no_free, int multiple_option,
500     const char *long_opt, char short_opt,
501     const char *additional_error)
502     {
503     char *stop_char = 0;
504     const char *val = value;
505     int found;
506     char **string_field;
507     FIX_UNUSED (field);
508    
509     stop_char = 0;
510     found = 0;
511    
512     if (!multiple_option && prev_given && (*prev_given || (check_ambiguity && *field_given)))
513     {
514     if (short_opt != '-')
515     fprintf (stderr, "%s: `--%s' (`-%c') option given more than once%s\n",
516     package_name, long_opt, short_opt,
517     (additional_error ? additional_error : ""));
518     else
519     fprintf (stderr, "%s: `--%s' option given more than once%s\n",
520     package_name, long_opt,
521     (additional_error ? additional_error : ""));
522     return 1; /* failure */
523     }
524    
525     FIX_UNUSED (default_value);
526    
527     if (field_given && *field_given && ! override)
528     return 0;
529     if (prev_given)
530     (*prev_given)++;
531     if (field_given)
532     (*field_given)++;
533     if (possible_values)
534     val = possible_values[found];
535    
536     switch(arg_type) {
537     case ARG_INT:
538     if (val) *((int *)field) = strtol (val, &stop_char, 0);
539     break;
540     case ARG_STRING:
541     if (val) {
542     string_field = (char **)field;
543     if (!no_free && *string_field)
544     free (*string_field); /* free previous string */
545     *string_field = gengetopt_strdup (val);
546     }
547     break;
548     default:
549     break;
550     };
551    
552     /* check numeric conversion */
553     switch(arg_type) {
554     case ARG_INT:
555     if (val && !(stop_char && *stop_char == '\0')) {
556     fprintf(stderr, "%s: invalid numeric value: %s\n", package_name, val);
557     return 1; /* failure */
558     }
559     break;
560     default:
561     ;
562     };
563    
564     /* store the original value */
565     switch(arg_type) {
566     case ARG_NO:
567     break;
568     default:
569     if (value && orig_field) {
570     if (no_free) {
571     *orig_field = value;
572     } else {
573     if (*orig_field)
574     free (*orig_field); /* free previous string */
575     *orig_field = gengetopt_strdup (value);
576     }
577     }
578     };
579    
580     return 0; /* OK */
581     }
582    
583    
584 chuckv 1098 int
585 gezelter 1629 cmdline_parser_internal (
586     int argc, char **argv, struct gengetopt_args_info *args_info,
587     struct cmdline_parser_params *params, const char *additional_error)
588 chuckv 1098 {
589     int c; /* Character of the parsed option. */
590    
591     int error = 0;
592     struct gengetopt_args_info local_args_info;
593 gezelter 1629
594     int override;
595     int initialize;
596     int check_required;
597     int check_ambiguity;
598    
599     package_name = argv[0];
600    
601     override = params->override;
602     initialize = params->initialize;
603     check_required = params->check_required;
604     check_ambiguity = params->check_ambiguity;
605 chuckv 1098
606     if (initialize)
607     cmdline_parser_init (args_info);
608    
609     cmdline_parser_init (&local_args_info);
610    
611 tim 320 optarg = 0;
612 gezelter 1629 optind = 0;
613     opterr = params->print_errors;
614 tim 320 optopt = '?';
615    
616     while (1)
617     {
618     int option_index = 0;
619    
620     static struct option long_options[] = {
621     { "help", 0, NULL, 'h' },
622     { "version", 0, NULL, 'V' },
623     { "input", 1, NULL, 'i' },
624     { "output", 1, NULL, 'o' },
625     { "sele1", 1, NULL, 0 },
626     { "sele2", 1, NULL, 0 },
627 tim 876 { "order", 1, NULL, 0 },
628 gezelter 1629 { "memory", 1, NULL, 'm' },
629 tim 320 { "rcorr", 0, NULL, 'r' },
630     { "vcorr", 0, NULL, 'v' },
631     { "dcorr", 0, NULL, 'd' },
632 tim 876 { "lcorr", 0, NULL, 'l' },
633 gezelter 1629 { "sdcorr", 0, NULL, 's' },
634 chuckv 1098 { "r_rcorr", 0, NULL, 0 },
635 chuckv 1112 { "thetacorr", 0, NULL, 0 },
636 xsun 1183 { "drcorr", 0, NULL, 0 },
637 chuckv 1245 { "helfandEcorr", 0, NULL, 0 },
638 gezelter 1629 { "momentum", 0, NULL, 'p' },
639     { "stresscorr", 0, NULL, 0 },
640     { 0, 0, 0, 0 }
641 tim 320 };
642    
643 gezelter 1629 c = getopt_long (argc, argv, "hVi:o:m:rvdlsp", long_options, &option_index);
644 tim 320
645     if (c == -1) break; /* Exit from `while (1)' loop. */
646    
647     switch (c)
648     {
649     case 'h': /* Print help and exit. */
650     cmdline_parser_print_help ();
651 chuckv 1098 cmdline_parser_free (&local_args_info);
652 tim 320 exit (EXIT_SUCCESS);
653    
654     case 'V': /* Print version and exit. */
655     cmdline_parser_print_version ();
656 chuckv 1098 cmdline_parser_free (&local_args_info);
657 tim 320 exit (EXIT_SUCCESS);
658    
659     case 'i': /* input dump file. */
660 gezelter 1629
661    
662     if (update_arg( (void *)&(args_info->input_arg),
663     &(args_info->input_orig), &(args_info->input_given),
664     &(local_args_info.input_given), optarg, 0, 0, ARG_STRING,
665     check_ambiguity, override, 0, 0,
666     "input", 'i',
667     additional_error))
668     goto failure;
669    
670 tim 320 break;
671     case 'o': /* output file name. */
672 gezelter 1629
673    
674     if (update_arg( (void *)&(args_info->output_arg),
675     &(args_info->output_orig), &(args_info->output_given),
676     &(local_args_info.output_given), optarg, 0, 0, ARG_STRING,
677     check_ambiguity, override, 0, 0,
678     "output", 'o',
679     additional_error))
680     goto failure;
681    
682 tim 320 break;
683 gezelter 1629 case 'm': /* Available memory (defaults to 2G). */
684    
685    
686     if (update_arg( (void *)&(args_info->memory_arg),
687     &(args_info->memory_orig), &(args_info->memory_given),
688     &(local_args_info.memory_given), optarg, 0, "2G", ARG_STRING,
689     check_ambiguity, override, 0, 0,
690     "memory", 'm',
691     additional_error))
692     goto failure;
693    
694     break;
695 tim 917 case 'r': /* rmsd. */
696 gezelter 1629
697 chuckv 1098 if (args_info->dynamicProps_group_counter && override)
698     reset_group_dynamicProps (args_info);
699     args_info->dynamicProps_group_counter += 1;
700 gezelter 1629
701     if (update_arg( 0 ,
702     0 , &(args_info->rcorr_given),
703     &(local_args_info.rcorr_given), optarg, 0, 0, ARG_NO,
704     check_ambiguity, override, 0, 0,
705     "rcorr", 'r',
706     additional_error))
707     goto failure;
708    
709 chuckv 1098 break;
710 tim 320 case 'v': /* velocity correlation function. */
711 gezelter 1629
712 chuckv 1098 if (args_info->dynamicProps_group_counter && override)
713     reset_group_dynamicProps (args_info);
714     args_info->dynamicProps_group_counter += 1;
715 gezelter 1629
716     if (update_arg( 0 ,
717     0 , &(args_info->vcorr_given),
718     &(local_args_info.vcorr_given), optarg, 0, 0, ARG_NO,
719     check_ambiguity, override, 0, 0,
720     "vcorr", 'v',
721     additional_error))
722     goto failure;
723    
724 chuckv 1098 break;
725 tim 320 case 'd': /* dipole correlation function. */
726 gezelter 1629
727 chuckv 1098 if (args_info->dynamicProps_group_counter && override)
728     reset_group_dynamicProps (args_info);
729     args_info->dynamicProps_group_counter += 1;
730 gezelter 1629
731     if (update_arg( 0 ,
732     0 , &(args_info->dcorr_given),
733     &(local_args_info.dcorr_given), optarg, 0, 0, ARG_NO,
734     check_ambiguity, override, 0, 0,
735     "dcorr", 'd',
736     additional_error))
737     goto failure;
738    
739 chuckv 1098 break;
740 tim 876 case 'l': /* Lengendre correlation function. */
741 gezelter 1629
742 chuckv 1098 if (args_info->dynamicProps_group_counter && override)
743     reset_group_dynamicProps (args_info);
744     args_info->dynamicProps_group_counter += 1;
745 gezelter 1629
746     if (update_arg( 0 ,
747     0 , &(args_info->lcorr_given),
748     &(local_args_info.lcorr_given), optarg, 0, 0, ARG_NO,
749     check_ambiguity, override, 0, 0,
750     "lcorr", 'l',
751     additional_error))
752     goto failure;
753    
754 chuckv 1098 break;
755 gezelter 1629 case 's': /* System dipole correlation function. */
756    
757     if (args_info->dynamicProps_group_counter && override)
758     reset_group_dynamicProps (args_info);
759     args_info->dynamicProps_group_counter += 1;
760    
761     if (update_arg( 0 ,
762     0 , &(args_info->sdcorr_given),
763     &(local_args_info.sdcorr_given), optarg, 0, 0, ARG_NO,
764     check_ambiguity, override, 0, 0,
765     "sdcorr", 's',
766     additional_error))
767     goto failure;
768    
769     break;
770     case 'p': /* Helfand momentum for viscosity. */
771    
772     if (args_info->dynamicProps_group_counter && override)
773     reset_group_dynamicProps (args_info);
774     args_info->dynamicProps_group_counter += 1;
775    
776     if (update_arg( 0 ,
777     0 , &(args_info->momentum_given),
778     &(local_args_info.momentum_given), optarg, 0, 0, ARG_NO,
779     check_ambiguity, override, 0, 0,
780     "momentum", 'p',
781     additional_error))
782     goto failure;
783    
784     break;
785 tim 320
786     case 0: /* Long option with no short option */
787     /* select first stuntdouble set. */
788     if (strcmp (long_options[option_index].name, "sele1") == 0)
789 tim 876 {
790 gezelter 1629
791    
792     if (update_arg( (void *)&(args_info->sele1_arg),
793     &(args_info->sele1_orig), &(args_info->sele1_given),
794     &(local_args_info.sele1_given), optarg, 0, 0, ARG_STRING,
795     check_ambiguity, override, 0, 0,
796     "sele1", '-',
797     additional_error))
798     goto failure;
799    
800 tim 876 }
801 tim 320 /* select second stuntdouble set (if sele2 is not set, use script from sele1). */
802     else if (strcmp (long_options[option_index].name, "sele2") == 0)
803 tim 876 {
804 gezelter 1629
805    
806     if (update_arg( (void *)&(args_info->sele2_arg),
807     &(args_info->sele2_orig), &(args_info->sele2_given),
808     &(local_args_info.sele2_given), optarg, 0, 0, ARG_STRING,
809     check_ambiguity, override, 0, 0,
810     "sele2", '-',
811     additional_error))
812     goto failure;
813    
814 tim 876 }
815     /* Lengendre Polynomial Order. */
816     else if (strcmp (long_options[option_index].name, "order") == 0)
817     {
818 gezelter 1629
819    
820     if (update_arg( (void *)&(args_info->order_arg),
821     &(args_info->order_orig), &(args_info->order_given),
822     &(local_args_info.order_given), optarg, 0, 0, ARG_INT,
823     check_ambiguity, override, 0, 0,
824     "order", '-',
825     additional_error))
826     goto failure;
827    
828 chuckv 1098 }
829     /* Radial rmsd. */
830     else if (strcmp (long_options[option_index].name, "r_rcorr") == 0)
831     {
832 gezelter 1629
833 chuckv 1098 if (args_info->dynamicProps_group_counter && override)
834     reset_group_dynamicProps (args_info);
835     args_info->dynamicProps_group_counter += 1;
836 gezelter 1629
837     if (update_arg( 0 ,
838     0 , &(args_info->r_rcorr_given),
839     &(local_args_info.r_rcorr_given), optarg, 0, 0, ARG_NO,
840     check_ambiguity, override, 0, 0,
841     "r_rcorr", '-',
842     additional_error))
843     goto failure;
844    
845 tim 876 }
846 chuckv 1112 /* Angular rmsd. */
847     else if (strcmp (long_options[option_index].name, "thetacorr") == 0)
848     {
849 gezelter 1629
850 chuckv 1112 if (args_info->dynamicProps_group_counter && override)
851     reset_group_dynamicProps (args_info);
852     args_info->dynamicProps_group_counter += 1;
853 gezelter 1629
854     if (update_arg( 0 ,
855     0 , &(args_info->thetacorr_given),
856     &(local_args_info.thetacorr_given), optarg, 0, 0, ARG_NO,
857     check_ambiguity, override, 0, 0,
858     "thetacorr", '-',
859     additional_error))
860     goto failure;
861    
862 chuckv 1112 }
863 xsun 1183 /* Directional rmsd for particles with unit vectors. */
864     else if (strcmp (long_options[option_index].name, "drcorr") == 0)
865     {
866 gezelter 1629
867 xsun 1183 if (args_info->dynamicProps_group_counter && override)
868     reset_group_dynamicProps (args_info);
869     args_info->dynamicProps_group_counter += 1;
870 gezelter 1629
871     if (update_arg( 0 ,
872     0 , &(args_info->drcorr_given),
873     &(local_args_info.drcorr_given), optarg, 0, 0, ARG_NO,
874     check_ambiguity, override, 0, 0,
875     "drcorr", '-',
876     additional_error))
877     goto failure;
878    
879 xsun 1183 }
880 chuckv 1245 /* Helfand moment for thermal conductvity. */
881     else if (strcmp (long_options[option_index].name, "helfandEcorr") == 0)
882     {
883 gezelter 1629
884 chuckv 1245 if (args_info->dynamicProps_group_counter && override)
885     reset_group_dynamicProps (args_info);
886     args_info->dynamicProps_group_counter += 1;
887 gezelter 1629
888     if (update_arg( 0 ,
889     0 , &(args_info->helfandEcorr_given),
890     &(local_args_info.helfandEcorr_given), optarg, 0, 0, ARG_NO,
891     check_ambiguity, override, 0, 0,
892     "helfandEcorr", '-',
893     additional_error))
894     goto failure;
895    
896 chuckv 1245 }
897 gezelter 1629 /* Stress tensor correlation function. */
898     else if (strcmp (long_options[option_index].name, "stresscorr") == 0)
899     {
900 tim 876
901 gezelter 1629 if (args_info->dynamicProps_group_counter && override)
902     reset_group_dynamicProps (args_info);
903     args_info->dynamicProps_group_counter += 1;
904    
905     if (update_arg( 0 ,
906     0 , &(args_info->stresscorr_given),
907     &(local_args_info.stresscorr_given), optarg, 0, 0, ARG_NO,
908     check_ambiguity, override, 0, 0,
909     "stresscorr", '-',
910     additional_error))
911     goto failure;
912    
913     }
914    
915 chuckv 1098 break;
916 tim 320 case '?': /* Invalid option. */
917     /* `getopt_long' already printed an error message. */
918 chuckv 1098 goto failure;
919 tim 320
920     default: /* bug: option not considered. */
921 chuckv 1098 fprintf (stderr, "%s: option unknown: %c%s\n", CMDLINE_PARSER_PACKAGE, c, (additional_error ? additional_error : ""));
922 tim 320 abort ();
923     } /* switch */
924     } /* while */
925    
926 chuckv 1098 if (args_info->dynamicProps_group_counter > 1)
927 tim 320 {
928 gezelter 1629 fprintf (stderr, "%s: %d options of group dynamicProps were given. One is required%s.\n", argv[0], args_info->dynamicProps_group_counter, (additional_error ? additional_error : ""));
929 chuckv 1098 error = 1;
930 tim 320 }
931    
932    
933 chuckv 1098
934     if (check_required)
935 tim 320 {
936 chuckv 1098 error += cmdline_parser_required2 (args_info, argv[0], additional_error);
937 tim 320 }
938    
939 chuckv 1098 cmdline_parser_release (&local_args_info);
940    
941     if ( error )
942     return (EXIT_FAILURE);
943    
944 gezelter 1629 if (optind < argc)
945     {
946     int i = 0 ;
947     int found_prog_name = 0;
948     /* whether program name, i.e., argv[0], is in the remaining args
949     (this may happen with some implementations of getopt,
950     but surely not with the one included by gengetopt) */
951    
952     i = optind;
953     while (i < argc)
954     if (argv[i++] == argv[0]) {
955     found_prog_name = 1;
956     break;
957     }
958     i = 0;
959    
960     args_info->inputs_num = argc - optind - found_prog_name;
961     args_info->inputs =
962     (char **)(malloc ((args_info->inputs_num)*sizeof(char *))) ;
963     while (optind < argc)
964     if (argv[optind++] != argv[0])
965     args_info->inputs[ i++ ] = gengetopt_strdup (argv[optind-1]) ;
966     }
967    
968 tim 320 return 0;
969 chuckv 1098
970     failure:
971    
972     cmdline_parser_release (&local_args_info);
973     return (EXIT_FAILURE);
974 tim 320 }

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